6-ethylcinnoline

C10H10N2 — CID 70647783

IUPAC6-ethylcinnoline
SMILESCCc1ccc2nnccc2c1
InChIInChI=1S/C10H10N2/c1-2-8-3-4-10-9(7-8)5-6-11-12-10/h3-7H,2H2,1H3
InChIKeyANSWZDRSNCSGRG-UHFFFAOYSA-N
MW158.20 g/mol
LogP2.19
Rot. Bonds1

About 6-ethylcinnoline

6-ethylcinnoline (PubChem CID 70647783) has the molecular formula C10H10N2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 6-ethylcinnoline.

Molecular Properties

Compound Name6-ethylcinnoline
PubChem CID70647783
Molecular FormulaC10H10N2
Molecular Weight158.20 g/mol
Exact Mass158.08
IUPAC Name6-ethylcinnoline
SMILESCCc1ccc2nnccc2c1
InChIInChI=1S/C10H10N2/c1-2-8-3-4-10-9(7-8)5-6-11-12-10/h3-7H,2H2,1H3
InChIKeyANSWZDRSNCSGRG-UHFFFAOYSA-N
XLogP2.19
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethylcinnoline?
The IUPAC name of 6-ethylcinnoline (CID 70647783) is 6-ethylcinnoline.
What is the SMILES notation for 6-ethylcinnoline?
The canonical SMILES for 6-ethylcinnoline is CCc1ccc2nnccc2c1.
What is the InChIKey of 6-ethylcinnoline?
The InChIKey is ANSWZDRSNCSGRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2/c1-2-8-3-4-10-9(7-8)5-6-11-12-10/h3-7H,2H2,1H3.
What are the key properties of 6-ethylcinnoline?
6-ethylcinnoline has a molecular weight of 158.20 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethylcinnoline is sourced from PubChem (CID 70647783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).